Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Lysine-specific histone demethylase 1A' and Ligand = 'BDBM456500'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM456500 (US10723742, Example 228 | US10723742, Example 241 ...) Show SMILES Cc1c(F)c(cc2nnn(CC(C)(C)O)c12)-c1ccc(cc1-c1ccc(C#N)c(F)c1)C(=O)N1[C@@H]2CC[C@H]1[C@@H](N)C2 |TLB:39:38:36.35:33| Show InChI InChI=1S/C31H30F2N6O2/c1-16-28(33)23(13-26-29(16)38(37-36-26)15-31(2,3)41)21-8-6-18(30(40)39-20-7-9-27(39)25(35)12-20)10-22(21)17-4-5-19(14-34)24(32)11-17/h4-6,8,10-11,13,20,25,27,41H,7,9,12,15,35H2,1-3H3/t20-,25+,27+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.110	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The conditions for measuring inhibitory activity of compounds against LSD1 activity were determined with reference to a document available from the w...				Citation and Details BindingDB Entry DOI: 10.7270/Q2NC6513
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM456500 (US10723742, Example 228 | US10723742, Example 241 ...) Show SMILES Cc1c(F)c(cc2nnn(CC(C)(C)O)c12)-c1ccc(cc1-c1ccc(C#N)c(F)c1)C(=O)N1[C@@H]2CC[C@H]1[C@@H](N)C2 |TLB:39:38:36.35:33| Show InChI InChI=1S/C31H30F2N6O2/c1-16-28(33)23(13-26-29(16)38(37-36-26)15-31(2,3)41)21-8-6-18(30(40)39-20-7-9-27(39)25(35)12-20)10-22(21)17-4-5-19(14-34)24(32)11-17/h4-6,8,10-11,13,20,25,27,41H,7,9,12,15,35H2,1-3H3/t20-,25+,27+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.110	n/a	n/a	n/a	n/a	n/a	n/a
Taiho Pharmaceutical Co., Ltd. US Patent					Assay Description The conditions for measuring inhibitory activity of compounds against LSD1 activity were determined with reference to a document available from the w...				US Patent US10723742 (2020) BindingDB Entry DOI: 10.7270/Q2TF01DB
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM456500 (US10723742, Example 228 | US10723742, Example 241 ...) Show SMILES Cc1c(F)c(cc2nnn(CC(C)(C)O)c12)-c1ccc(cc1-c1ccc(C#N)c(F)c1)C(=O)N1[C@@H]2CC[C@H]1[C@@H](N)C2 |TLB:39:38:36.35:33| Show InChI InChI=1S/C31H30F2N6O2/c1-16-28(33)23(13-26-29(16)38(37-36-26)15-31(2,3)41)21-8-6-18(30(40)39-20-7-9-27(39)25(35)12-20)10-22(21)17-4-5-19(14-34)24(32)11-17/h4-6,8,10-11,13,20,25,27,41H,7,9,12,15,35H2,1-3H3/t20-,25+,27+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.290	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The conditions for measuring inhibitory activity of compounds against LSD1 activity were determined with reference to a document available from the w...				Citation and Details BindingDB Entry DOI: 10.7270/Q2NC6513
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM456500 (US10723742, Example 228 | US10723742, Example 241 ...) Show SMILES Cc1c(F)c(cc2nnn(CC(C)(C)O)c12)-c1ccc(cc1-c1ccc(C#N)c(F)c1)C(=O)N1[C@@H]2CC[C@H]1[C@@H](N)C2 |TLB:39:38:36.35:33| Show InChI InChI=1S/C31H30F2N6O2/c1-16-28(33)23(13-26-29(16)38(37-36-26)15-31(2,3)41)21-8-6-18(30(40)39-20-7-9-27(39)25(35)12-20)10-22(21)17-4-5-19(14-34)24(32)11-17/h4-6,8,10-11,13,20,25,27,41H,7,9,12,15,35H2,1-3H3/t20-,25+,27+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.290	n/a	n/a	n/a	n/a	n/a	n/a
Taiho Pharmaceutical Co., Ltd. US Patent					Assay Description The conditions for measuring inhibitory activity of compounds against LSD1 activity were determined with reference to a document available from the w...				US Patent US10723742 (2020) BindingDB Entry DOI: 10.7270/Q2TF01DB
					More data for this Ligand-Target Pair